AC1NZZ5P structure

AC1NZZ5P

ethyl 1-[3-[(Z)-(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-9-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl]piperidine-4-carboxylate

Also Known As: ethyl 1-{3-[(Z)-(3-benzyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}piperidine-4-carboxylate|(Z)-ethyl 1-(3-((3-benzyl-4-oxo-2-thioxothiazolidin-5-ylidene)methyl)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)piperidine-4-carboxylate|ethyl 1-(9-methyl-4-oxo-3-{[4-oxo-3-benzyl-2-thioxo(1,3-thiazolidin-5-ylidene) ]methyl}-5-hydropyridino[1,2-a]pyrimidin-2-yl)piperidine-4-carboxylate|ethyl 1-[3-[(Z)-(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-9-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl]piperidine-4-carboxylate

CAS: 615271-64-2
Molecular Formula C28H28N4O4S2
Molecular Weight 548.1552 g/mol
LogP 4.18382
Topological Polar Surface Area 84.22 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 8
Rotatable Bonds 6
Exact Mass 548.1552
Monoisotopic Mass 548.1552
Heavy Atoms 38
Complexity 1493.9696

Chemical Identifiers

CAS Number 615271-64-2
SMILES CCOC(=O)C1CCN(CC1)C2=C(C(=O)N3C=CC=C(C3=N2)C)/C=C\4/C(=O)N(C(=S)S4)CC5=CC=CC=C5

Product Overview

AC1NZZ5P (CAS 615271-64-2), with molecular formula C28H28N4O4S2 and molecular weight 548.1552 g/mol. IUPAC: ethyl 1-[3-[(Z)-(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-9-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl]piperidine-4-carboxylate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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